{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.1028 0.2583089 1.436622 ] [ 0.0542075 1.282802 2.764068 ] [ 0.3917807 2.567162 0.7355983 ] [ 2.495357 1.268739 0.0869323 ] [ 2.96001 0.2024969 2.578704 ] [ 2.541972 2.542294 2.28683 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1028e-10 2.583089e-11 1.436622e-10 ] [ 5.42075e-12 1.282802e-10 2.764068e-10 ] [ 3.917807e-11 2.567162e-10 7.355983000000001e-11 ] [ 2.495357e-10 1.268739e-10 8.693230000000001e-12 ] [ 2.96001e-10 2.024969e-11 2.578704e-10 ] [ 2.541972e-10 2.542294e-10 2.28683e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9835244 -4.6624485 -4.305067 ] [ -2.7056138 3.7330982 3.9020213 ] [ 0.9151104 -0.5207412 0.4696866 ] [ 0.4717612 1.2102174 -0.0463114 ] [ 0.8095497 0.4851946 0.4086362 ] [ -0.4743319 -0.2453204 -0.4289657 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.575779799666347e-09 -7.470065982384029e-09 -6.897477698377594e-09 ] [ -4.334871175273848e-09 5.981082659190563e-09 6.251727300723623e-09 ] [ 1.466168488330936e-09 -8.34319376127337e-10 7.525208896230413e-10 ] [ 7.55844765240553e-10 1.938982024365362e-09 -7.419904235651712e-11 ] [ 1.297041602715654e-09 7.773674446584077e-10 6.54707366052553e-10 ] [ -7.599634806796435e-10 -3.930466094853043e-10 -6.872788156651066e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -15.09349 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.418243680427859e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8113125 -0.0485379 1.0491372 ] [ 0.5230506 1.3756773 2.9866962 ] [ 0.5027595 2.3366134 0.7636722 ] [ 2.6589912 1.3315834 0.3095552 ] [ 2.6792869 0.3706594 2.5325789 ] [ 2.3707264 2.7558071 2.2471149 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.113125e-11 -4.85379e-12 1.0491372e-10 ] [ 5.230506e-11 1.3756773e-10 2.9866962e-10 ] [ 5.027595e-11 2.3366134e-10 7.636722e-11 ] [ 2.6589912e-10 1.3315834e-10 3.095552e-11 ] [ 2.6792869e-10 3.706594e-11 2.5325789e-10 ] [ 2.3707264e-10 2.7558071e-10 2.2471149e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.39e-05 2.82e-05 1.12e-05 ] [ 2.53e-05 1.03e-05 -2.64e-05 ] [ 2.53e-05 -3.18e-05 2.25e-05 ] [ -2.47e-05 1.06e-05 2.4e-05 ] [ -3.39e-05 1.33e-05 -1.79e-05 ] [ -1.59e-05 -3.07e-05 -1.33e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.829202123712e-14 4.518138070656001e-14 1.794437815296e-14 ] [ 4.053506850624e-14 1.650241919424e-14 -4.229746278912e-14 ] [ 4.053506850624e-14 -5.094921654144e-14 3.604897396800001e-14 ] [ -3.957376253376001e-14 1.698307218048e-14 3.84522388992e-14 ] [ -5.431378744512e-14 2.130894905664e-14 -2.867896151232001e-14 ] [ -2.547460827072e-14 -4.918682225856e-14 -2.130894905664e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.290227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.770199746772493e-18 } }